| SpectraBase Spectrum ID |
h1gfhPqZ4C |
| Name |
3-Hydroxytridecanoate |
| CAS Registry Number |
150024-70-7 |
| Classification |
Fatty esters; Fatty acid methyl esters |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
244.203844759 u |
| Formula |
C14H28O3 |
| InChI |
InChI=1S/C14H28O3/c1-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17-2/h13,15H,3-12H2,1-2H3 |
| InChIKey |
MBIWBGYNTOAAKH-UHFFFAOYSA-N |
| Molecular Weight |
244.375 g/mol |
| Number of Peaks |
164 |
| RI2 |
1781 |
| RI4 |
1768 |
| RI5 |
1445 |
| SMILES |
OC(CC(=O)OC)CCCCCCCCCC |
| SPLASH |
splash10-0udl-9500000000-1cfb9a054e5f8805522c |
| Sample Comments |
RI1: measured on Equity-1 (Alkanes)
RI2: measured on Supelcowax-10 (FAMEs)
RI3: measured on Supelcowax-10 (FAEEs)
RI4: measured on SLB-5ms (Alkanes)
RI5: measured on SLB-5ms (FAMEs) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Tridecanoic acid, 3-hydroxy-, methyl ester
Me. 3-OH C13:0 |
| Wiley ID |
LM_LIPIDS2016_186 |
